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F and Cl-Functionalized Cr2b2 Mbene as Potential Anode Materials for Li/Na-Ion Batteries with High Charge Storage Capacity: A Dft Study

https://doi.org/10.2139/ssrn.4648471
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High-Throughput Computational Screening of Two-Dimensional Semiconductors
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Recent Developments of Two-Dimensional Anode Materials and Their Composites in Lithium-Ion Batteries
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2D Dumbbell Silicene as a High Storage Capacity and Fast Ion Diffusion Anode for Li-Ion Batteries
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Aluminene as a Low-Cost Anode Material for Li- and Na-Ion Batteries
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Twin-graphene as a Promising Anode Material for Na-Ion Rechargeable Batteries
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Two-Dimensional α-SiX (X = N, P) Monolayers as Efficient Anode Material for Li-Ion Batteries: A First-Principles Study
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First-Principles Calculations of TiB MBene Monolayers for Hydrogen Evolution
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Ti3C2 MXene as a High Capacity Electrode Material for Metal (Li, Na, K, Ca) Ion Batteries
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Atoms in molecules
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Investigations on Nb 2 C monolayer as promising anode material for Li or non-Li ion batteries from first-principles calculations
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Electrolyte design strategies and research progress for room-temperature sodium-ion batteries
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Mo 2 B, an MBene member with high electrical and thermal conductivities, and satisfactory performances in lithium ion batteries
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Pentagonal B 2 C monolayer with extremely high theoretical capacity for Li-/Na-ion batteries
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Mo 2 B 2 MBene-supported single-atom catalysts as bifunctional HER/OER and OER/ORR electrocatalysts
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A generalized solid-state nudged elastic band method
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A systematical ab-initio review of promising 2D MXene monolayers towards Li-ion battery applications
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Arsenene: Two-dimensional buckled and puckered honeycomb arsenic systems
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Computational evaluation of ScB and TiB MBenes as promising anode materials for high-performance metal-ion batteries
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Mo2C as a high capacity anode material: a first-principles study
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Recent Advances in Anode Materials for Sodium-Ion Batteries
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